108 Lattice="10.610920619108725 0.0 0.0 0.0 10.610920619108725 0.0 0.0 0.0 10.610920619108725" Properties=species:S:1:pos:R:3:forces:R:3 energy=-325.1155634101991 stress="-0.005921248741969838 0.0008604665934352361 5.2779408378122924e-06 0.0008604665934352361 -0.0060965761237885595 -0.0007120437488160425 5.2779408378122924e-06 -0.0007120437488160425 -0.0057700983678915215" pbc="F F F" Cu 0.01689662 0.03203069 0.02198230 0.30133464 0.27608719 0.37248987 Cu 1.73322776 1.74301955 0.01855451 0.10317682 0.17834282 -0.36315231 Cu 1.76169673 0.00401021 1.77341380 0.17689650 -0.43525814 -0.14085790 Cu 0.02334831 1.73582126 1.79175835 -0.38690082 0.22106039 -0.26430220 Cu 3.55822348 0.02430846 0.02761903 -0.09757375 0.09275894 0.10818828 Cu 5.27715276 1.79884717 0.00879112 0.35579523 -0.30184820 -0.35326358 Cu 5.30434825 0.00048389 1.78749443 -0.11107057 -0.19901963 -0.14509084 Cu 3.51015290 1.78490784 1.73920463 0.12751169 -0.27749855 0.24097057 Cu 7.05260799 0.03264212 0.02058768 0.04220490 0.27350745 0.26122737 Cu 8.86744660 1.74547328 0.01858221 -0.43569045 0.08929315 0.36935351 Cu 8.82961282 0.01604664 1.79592322 -0.21684569 0.24881090 -0.04569145 Cu 7.07581680 1.74382995 1.79435075 0.19269719 0.23210575 -0.40305111 Cu 0.02266934 3.56860848 0.03423544 0.05721010 -0.24557504 0.10733352 Cu 1.77532592 5.27377797 0.01709946 0.11058577 0.18516020 -0.31139115 Cu 1.76019717 3.54608902 1.79437416 0.15227263 -0.23803942 -0.21379505 Cu 0.02221719 5.27668972 1.78368045 -0.51537063 0.14687677 -0.12750655 Cu 3.55600804 3.51622219 0.00575376 -0.28986569 0.19739710 -0.43219712 Cu 5.32461414 5.32968390 0.00443813 -0.08247215 -0.09296222 -0.39839354 Cu 5.31011458 3.52546052 1.73454351 0.20332673 0.05118534 0.22906570 Cu 3.56326724 5.27197107 1.80025025 -0.17317766 0.22909866 -0.22575782 Cu 7.08442556 3.56848375 0.03057613 0.19197266 -0.31415898 -0.34877702 Cu 8.83069238 5.32856202 0.02516593 -0.08709511 -0.07340893 0.14950887 Cu 8.84490440 3.52027621 1.79899545 0.19787202 -0.07837185 -0.25691556 Cu 7.05902047 5.32525107 1.75768981 0.19166112 -0.12121349 0.14922016 Cu 0.02926329 7.06301734 0.02948300 0.23348218 0.00716048 0.27949332 Cu 1.73662694 8.85910729 0.01742928 0.13321359 -0.43610395 0.36488836 Cu 1.76424532 7.04228855 1.77951898 0.11991947 0.34990532 -0.25433732 Cu 0.01297003 8.85247425 1.78232185 0.34629593 -0.34455268 0.02728045 Cu 3.56747486 7.05615205 0.01652878 -0.32492088 0.13855999 -0.33214061 Cu 5.33840842 8.84612748 0.02845134 -0.05817889 -0.12433959 -0.01538486 Cu 5.29442034 7.09464723 1.76317338 0.06734780 -0.16331497 0.16116398 Cu 3.55930320 8.82288729 1.73929143 -0.23307072 0.36925768 0.07373437 Cu 7.08575450 7.08379584 0.02688617 0.09981123 0.06205664 -0.46482353 Cu 8.87035800 8.81717686 0.01203981 -0.46680476 -0.43698799 0.43813024 Cu 8.87117014 7.07274454 1.75303643 0.20644935 0.12846323 0.14686848 Cu 7.07861302 8.81222347 1.74312463 0.26641108 0.38746885 0.15395085 Cu 0.04504005 0.04212125 3.51006562 -0.08849522 -0.17572067 0.13914717 Cu 1.80331471 1.73438181 3.55376987 -0.08613291 0.28527246 -0.10787135 Cu 1.78138984 0.00819440 5.29457827 -0.08090398 -0.43449889 0.15966872 Cu 0.00379000 1.74136299 5.29623945 -0.29094420 0.11198975 0.10810398 Cu 3.53812656 0.00896841 3.55851142 0.14643032 -0.35285175 -0.25814991 Cu 5.34015804 1.80152606 3.53590229 -0.38527131 -0.34981052 -0.19728364 Cu 5.27361772 0.02419797 5.33718192 0.28697665 -0.43495705 -0.04409868 Cu 3.56626998 1.75952559 5.30080244 -0.14672128 0.10889020 -0.04633164 Cu 7.05219921 0.02221176 3.51681764 0.15103293 -0.48332357 0.29771293 Cu 8.83078920 1.77328790 3.58552677 0.39157202 -0.12840300 -0.21053887 Cu 8.84349838 0.00797730 5.30468013 -0.37054131 0.24486114 0.08647474 Cu 7.04543588 1.79950965 5.27675424 0.23258073 -0.53653285 0.48633403 Cu 0.03116106 3.49057488 3.51552859 -0.46897980 0.07243371 0.24525333 Cu 1.74527344 5.29815180 3.55015210 0.28794793 -0.13336826 0.08028903 Cu 1.77471654 3.51527058 5.31046989 -0.10460352 0.05662827 -0.13476287 Cu 0.00721909 5.30816223 5.33040206 -0.43558527 -0.14463883 -0.14339122 Cu 3.57081961 3.50403759 3.51444695 -0.32118130 0.11215785 0.18430939 Cu 5.31230363 5.27684757 3.54471788 -0.10050787 0.25887971 -0.23564017 Cu 5.31894852 3.55187901 5.27888852 -0.12566536 -0.00911374 0.42027322 Cu 3.53655912 5.28629783 5.31278379 -0.15723571 0.12017939 -0.09360488 Cu 7.07157634 3.53568339 3.56380030 0.21769956 0.17728813 -0.44945284 Cu 8.85752275 5.27608737 3.50566078 0.22716148 0.18042409 0.20904668 Cu 8.82797454 3.51290287 5.33684962 0.42627617 0.20891415 -0.09010550 Cu 7.05186732 5.31751003 5.28502065 0.34410140 -0.07889051 0.18382692 Cu 0.02373931 7.04946544 3.50472943 -0.45147729 0.32223460 0.12844899 Cu 1.80256679 8.85995802 3.54682016 -0.31683613 0.27465436 -0.34898881 Cu 1.74651709 7.08900733 5.27468076 0.09912984 -0.10357989 0.16064921 Cu 0.03224972 8.85474974 5.30276932 0.09312672 -0.13804592 -0.13409003 Cu 3.52287320 7.07395821 3.53845433 0.13035497 -0.08731182 -0.15190376 Cu 5.33791461 8.85046189 3.53689014 -0.06010030 0.25631152 0.02684040 Cu 5.27342184 7.06250133 5.29524480 0.25198214 0.16312003 -0.11082124 Cu 3.50224392 8.82008377 5.27514097 0.28307557 0.54781519 0.12394352 Cu 7.06571889 7.04489001 3.52291697 0.27874731 0.35734115 0.11337712 Cu 8.83443154 8.85385130 3.53773246 -0.31055137 -0.32316097 -0.04514370 Cu 8.86000621 7.08394748 5.31465624 0.16068060 0.09365217 -0.14330415 Cu 7.09264217 8.85856239 5.33816818 0.06193158 0.08723909 -0.16528807 Cu 0.03424277 0.03023097 7.06646702 0.25179658 0.21273722 0.09341964 Cu 1.79910335 1.76990838 7.05620850 -0.27662552 -0.15325294 0.34440342 Cu 1.73633559 0.00183970 8.87403469 0.08521132 0.39852014 -0.37264892 Cu 0.01624812 1.78215839 8.83571084 0.30397607 -0.07981177 -0.22343049 Cu 3.50494571 0.02315171 7.09516464 0.09187733 -0.39716240 0.20518830 Cu 5.27271152 1.80208801 7.06717931 0.31167844 -0.28726901 0.24237224 Cu 5.32642663 0.00773615 8.86104488 -0.15371523 0.20215007 -0.26614340 Cu 3.54560510 1.77138027 8.86573875 -0.20441866 -0.12859422 0.24914922 Cu 7.06456432 0.02576219 7.11241561 0.15464734 -0.15794355 -0.14671487 Cu 8.84350416 1.76693780 7.08395478 0.16639860 -0.22836991 0.12430610 Cu 8.84603769 0.03136003 8.87546746 -0.50675333 0.47433834 -0.51022542 Cu 7.05059634 1.74140185 8.87692656 0.23826953 0.15145530 0.14707360 Cu 0.02198480 3.50846883 7.10324909 -0.38509483 0.04376832 -0.16620995 Cu 1.73933048 5.32686977 7.05716212 0.25415307 0.04167533 0.23780226 Cu 1.75816564 3.56335524 8.82493098 0.22352962 -0.15841640 0.33012634 Cu 0.03184860 5.28549368 8.86019463 0.15509061 0.27263293 -0.28903956 Cu 3.53179380 3.52076691 7.04389718 -0.01817560 0.23380005 0.34339326 Cu 5.29916203 5.31578866 7.08591804 0.11687111 -0.31394700 -0.07549211 Cu 5.29017780 3.50872544 8.85970053 0.14822799 0.20290753 0.22454267 Cu 3.56154674 5.32611881 8.82477296 -0.35188571 -0.14455477 0.26044751 Cu 7.09256065 3.51079630 7.07839545 -0.22066738 0.15734340 0.12778576 Cu 8.84527269 5.32097897 7.04589925 0.27845713 -0.03846598 0.10776860 Cu 8.83440788 3.56461115 8.81460290 -0.11531568 -0.18535646 -0.12574328 Cu 7.10461082 5.29586138 8.82926290 -0.12156888 0.08476803 0.27334596 Cu 0.02611113 7.11073002 7.04330214 -0.32414670 0.02628298 0.41521491 Cu 1.78208495 8.85664144 7.04774285 -0.15616507 0.29575203 0.22678051 Cu 1.79567665 7.12372916 8.84347986 -0.31021030 -0.24765445 0.13552519 Cu 0.02120541 8.84297235 8.86087059 0.52087887 -0.48713710 -0.56598836 Cu 3.55027764 7.10510859 7.04928796 -0.30645695 -0.23819943 0.06697529 Cu 5.31026969 8.82332768 7.04958753 0.09988400 0.34639983 0.25709074 Cu 5.28033665 7.04308653 8.83180790 0.39852492 0.36424716 0.33529761 Cu 3.53026695 8.79502024 8.82443203 0.11568044 0.09355813 -0.09339495 Cu 7.05870499 7.04312521 7.04279964 0.25578478 0.47705260 0.37964349 Cu 8.86065834 8.87364359 7.07322409 -0.43407020 -0.44934304 0.06177251 Cu 8.84590107 7.08284662 8.80970342 -0.32757230 0.03524373 -0.34473976 Cu 7.10724503 8.84966580 8.87362638 -0.12558006 -0.52713664 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